[(2,3-dihydro-1,4-benzodioxin-6-ylmethylamino)-thiophen-3-yl-methyl]phosphonic acid

Systemtic Name: [(2,3-dihydro-1,4-benzodioxin-6-ylmethylamino)-thiophen-3-yl-methyl]phosphonic acid Openeye Name: [(2,3-dihydro-1,4-benzodioxin-6-ylmethylamino)-(3-thienyl)methyl]phosphonic acid CAS Name: [(2,3-dihydro-1,4-benzodioxin-6-ylmethylamino)-(3-thiophenyl)methyl]phosphonic acid IUPAC Name: [(2,3-dihydro-1,4-benzodioxin-6-ylmethylamino)-thiophen-3-ylmethyl]phosphonic acid Traditional Name: [(2,3-dihydro-1,4-benzodioxin-6-ylmethylamino)-(3-thienyl)methyl]phosphonic acid Formula: C14H16NO5PS MolecularWeight: 341.319301

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)CNC(C3=CSC=C3)P(=O)(O)O

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)CNC(C3=CSC=C3)P(=O)(O)O

InChI

InChI=1S/C14H16NO5PS/c16-21(17,18)14(11-3-6-22-9-11)15-8-10-1-2-12-13(7-10)20-5-4-19-12/h1-3,6-7,9,14-15H,4-5,8H2,(H2,16,17,18)